(3-oxidanylidenecyclohexen-1-yl) 2,4-bis(bromanyl)-3-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methoxy]benzoate

Systemtic Name: (3-oxidanylidenecyclohexen-1-yl) 2,4-bis(bromanyl)-3-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methoxy]benzoate Openeye Name: (3-oxocyclohexen-1-yl) 2,4-dibromo-3-[(3-phenyl-4,5-dihydroisoxazol-5-yl)methoxy]benzoate CAS Name: 2,4-dibromo-3-[(3-phenyl-4,5-dihydroisoxazol-5-yl)methoxy]benzoic acid (3-oxo-1-cyclohexenyl) ester IUPAC Name: (3-oxocyclohexen-1-yl) 2,4-dibromo-3-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methoxy]benzoate Traditional Name: 2,4-dibromo-3-[(3-phenyl-2-isoxazolin-5-yl)methoxy]benzoic acid (3-ketocyclohexen-1-yl) ester Formula: C23H19Br2NO5 MolecularWeight: 549.20866

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)OC(=O)C2=C(C(=C(C=C2)Br)OCC3CC(=NO3)C4=CC=CC=C4)Br

Isomeric SMILES

C1CC(=CC(=O)C1)OC(=O)C2=C(C(=C(C=C2)Br)OCC3CC(=NO3)C4=CC=CC=C4)Br

InChI

InChI=1S/C23H19Br2NO5/c24-19-10-9-18(23(28)30-16-8-4-7-15(27)11-16)21(25)22(19)29-13-17-12-20(26-31-17)14-5-2-1-3-6-14/h1-3,5-6,9-11,17H,4,7-8,12-13H2